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75345-27-6

Basic Information
CAS No.: 75345-27-6
Name: Poly[(dimethyliminio)-2-butene-1,4-diylchloride (1:1)], a-[4-[tris(2-hydroxyethyl)ammonio]-2-buten-1-yl]-w-[tris(2-hydroxyethyl)ammonio]-,chloride (1:2)
Molecular Structure:
Molecular Structure of 75345-27-6 (Poly[(dimethyliminio)-2-butene-1,4-diylchloride (1:1)], a-[4-[tris(2-hydroxyethyl)ammonio]-2-buten-1-yl]-w-[tris(2-hydroxyethyl)ammonio]-,chloride (1:2))
Formula: C22H48Cl3N3O6
Molecular Weight: 556.99
Synonyms: Poly[(dimethyliminio)-2-butene-1,4-diylchloride], a-[4-[tris(2-hydroxyethyl)ammonio]-2-butenyl]-w-[tris(2-hydroxyethyl)ammonio]-,dichloride (9CI);Onamer M;Onyxsperse 12S;Polidronium chloride;Polyquad;Polyquaternium 1;(2E)-N,N,N-tris(2-hydroxyethyl)-N',N'-dimethyl-N'-{(2E)-4-[tris(2-hydroxyethyl)ammonio]but-2-en-1-yl}but-2-ene-1,4-diaminium trichloride;
EINECS: N/A
Density: N/A
Melting Point: N/A
Boiling Point: N/A
Flash Point: N/A
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 0.00000
LogP: 0.00000
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    Tel:+86-0531-58966870

    Address:136 Jingyi Road,Huaiyin District,Jinan,Shandong,China

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  • High purity Polyquaternium-1

  • Casno:

    75345-27-6

    High purity Polyquaternium-1

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 0.0-0.0/Kilogram

    Why choice me: √1, We guarantee deeply analyze and demonstrate, purity more than 99% √ 2, Factory outlet with priority price & large stock. √ 3, Special magic vacuum safe package & safe shipping way.All parcel shi

    Zibo Dorne chemical technology co., LTD. Is a comprehensive chemical enterprise integrating r&d, production and sales. It is a leading manufacturer and supplier of chemical product

  •  Zibo Dorne chemical technology co. LTD

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    Business Type:Lab/Research institutions

    Tel:+86-13583358881

    Address:No. 416, 4th floor, zhongguancun science and technology city, no. 1, west 6th road, zhangdian district

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  • Polidronium chloride

  • Casno:

    75345-27-6

    Polidronium chloride

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0/

    High quality,stable supply chain.Appearance:white/off-white or light yellow Storage:Store in cool and dry place, keep away from strong light and heat. Package:aluminum bottle,glass bottle,PTFE bottle,cardboard drum Application:This product can be use

    Suzhou Health Chemicals Co., Ltd. is A Fine Chemicals Company, specializing in research, development, manufacture and distribute raw materials for pharmaceutical, healthcare, bioch

  •  Suzhou Health Chemicals Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86-512-58277800

    Address:No. 338, Jingang Avenue,

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Specification

The Poly[(dimethyliminio)-2-butene-1,4-diylchloride (1:1)], a-[4-[tris(2-hydroxyethyl)ammonio]-2-buten-1-yl]-w-[tris(2-hydroxyethyl)ammonio]-,chloride (1:2), with the CAS registry number 75345-27-6, is also known as Polidronium chloride. This chemical's molecular formula is C22H48Cl3N3O6 and molecular weight is 556.99. What's more, its systematic name is (2E)-N,N,N-tris(2-hydroxyethyl)-N',N'-dimethyl-N'-{(2E)-4-[tris(2-hydroxyethyl)ammonio]but-2-en-1-yl}but-2-ene-1,4-diaminium trichloride.

Physical properties of Poly[(dimethyliminio)-2-butene-1,4-diylchloride (1:1)], a-[4-[tris(2-hydroxyethyl)ammonio]-2-buten-1-yl]-w-[tris(2-hydroxyethyl)ammonio]-,chloride (1:2) are: (1)ACD/LogP: -9.90; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -9.9; (4)ACD/LogD (pH 7.4): -9.9; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 9; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 26; (12)Polar Surface Area: 55.38 Å2.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: [Cl-].[Cl-].[Cl-].OCC[N+](CCO)(CCO)C/C=C/C[N+](C/C=C/C[N+](CCO)(CCO)CCO)(C)C
(2)InChI: InChI=1/C22H48N3O6.3ClH/c1-23(2,7-3-5-9-24(11-17-26,12-18-27)13-19-28)8-4-6-10-25(14-20-29,15-21-30)16-22-31;;;/h3-6,26-31H,7-22H2,1-2H3;3*1H/q+3;;;/p-3/b5-3+,6-4+;;;
(3)InChIKey: OTIWYSKRSMXGNK-UQMLEKAQBT